Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:18:58 UTC
Update Date2025-03-21 18:35:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00107836
Frequency24.9
Structure
Chemical FormulaC4H7O5P
Molecular Mass166.0031
SMILESC=C(OP(=O)(O)O)C(C)=O
InChI KeyBFRUOAGIQDNRAZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic phosphoric acids and derivatives
Subclass phosphate esters
Direct Parent phosphate esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • acryloyl compounds
  • alpha-branched alpha,beta-unsaturated ketones
  • enones
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • Substituents
  • alpha-branched alpha,beta-unsaturated-ketone
  • aliphatic acyclic compound
  • carbonyl group
  • alpha,beta-unsaturated ketone
  • ketone
  • organic oxide
  • organic oxygen compound
  • phosphoric acid ester
  • hydrocarbon derivative
  • acryloyl-group
  • organooxygen compound
  • enone